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Home Fluorides 79676-56-5
79676-56-5,MFCD01631518
Catalog No.:AA0050UO

79676-56-5 | 2-((Difluoromethyl)thio)benzoic acid

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250mg
in stock  
$24.00   $17.00
- +
1g
in stock  
$56.00   $39.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0050UO
Chemical Name:
2-((Difluoromethyl)thio)benzoic acid
CAS Number:
79676-56-5
Molecular Formula:
C8H6F2O2S
Molecular Weight:
204.1938
MDL Number:
MFCD01631518
SMILES:
FC(Sc1ccccc1C(=O)O)F
Properties
Computed Properties
 
Complexity:
187  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.9  

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:79676-56-5 Molecular Formula|79676-56-5 MDL|79676-56-5 SMILES|79676-56-5 2-((Difluoromethyl)thio)benzoic acid